File name: Pandora21s1_Bremen_20210519_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T072234.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20210519_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20210519 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20210519T062942.9Z 7809.270636 224 1 36.88 2 64.06 91.12 107.39 17.01 0.00 1 0.00 1 0 25 4.108e-02 6.608e-03 3.985e-02 4.646e-03 3.703291e-01 2.443287e-03 4.851037e-03 -6.000000e+00 2.478561e-02 231.40 -2.00 3.88 -2.00 318.94 0.00e+00 4.425615e-04 5.008699e-04 1.518932e-04 -6.000000e+00 9.842647e-04 276.60 -2.00 20.00 -2.00 318.63 0.00e+00 2.272 0.000 302.00 328.00 3 5.5700e+00 6.6552e-03 3.1541e-02 -6.0000e+00 6.2536e-02 4.2562e-02 7.5247e-03 2.1510e-02 -6.0000e+00 6.7801e-02 4.6387e-03 5.5847e-03 1.0773e-02 -6.0000e+00 3.9745e-02 -8.9921e-03 2.9638e-03 3.1250e-03 -6.0000e+00 1.6352e-02 1.2678e-04 -7.4119e-04 1.4701e-04 3.7942e-05 -6.0000e+00 1.2350e-03 9.3054e-04 -5.4043e-05 12 9 1 12 1 1 99.95 22.37 0.29 0.00093 -0.00464 10 3 1 5 0 3336.206 25.39 20.00 22.37 18.22 24.5 1001.65 -17570 12462 2500 5846 -13757 2197 -10831 1971 3453 -21933 -13744 -4969 -687 -10233 7068 -9578 13082 1089 4341 -2458 -3969 -3540 -1234 3274 -2887 -5848 678 321 -2594 4699 1751 2155 2388 -3085 7623 -1766 3024 -3626 2990 -2353 -716 -381 -2333 -656 -823 -1283 -1990 -1238 -994 1820 3577 268 2431 -305 574 346 2875 -535 2656 760 2711 1008 1031 377 -43 -20 -623 653 465 234 -649 -557 -203 -239 -139 -519 -290 -383 1110 186 479 -1335 -1213 -1178 -702 -228 -649 488 -603 391 -7 19 550 2280 1153 498 843 102 -76 -949 255 -46 -307 -812 -1469 -25 -888 -66 -514 256 -21 463 9 112 105 401 78 327 24 -600 -485 43 32 310 -113 711 1031 701 -57 409 264 426 132 -248 78 101 133 -358 -92 -734 18 -366 361 -662 394 90 197 -518 70 -411 74 142 -1215 -727 -258 -39 -744 506 -900 1068 106 431 -271 -457 -410 -144 389 -387 -842 92 42 -338 575 237 322 389 -551 1201 -303 534 -794 732 -703 -233 -131 -847 -239 -301 -474 -738 -453 -364 666 1362 113 1077 -147 285 177 1468 -282 1343 389 1398 563 623 245 -28 -13 -382 391 296 165 -500 -449 -163 -187 -102 -351 -180 -230 687 129 370 -1152 -1121 -1146 -718 -246 -736 564 -706 443 -7 19 516 2060 1099 521 968 129 -102 -1289 329 -56 -353 -940 -1799 -32 -1187 -91 -749 393 -35 766 15 177 157 568 109 468 35 -949 -782 68 50 469 -165 995 1391 943 -81 617 420 701 224 -435 142 192 259 -712 -183 -1456 34 -680 651 SS 20210519T063810.4Z 7809.276509 230 1 11.79 2 62.79 92.83 107.04 18.99 0.00 1 0.00 1 0 25 1.603e-02 5.135e-03 9.817e-03 2.027e-03 3.534924e-01 1.064972e-03 4.663033e-03 -6.000000e+00 9.671829e-03 231.40 -2.00 3.88 -2.00 317.91 0.00e+00 2.350880e-04 1.651887e-04 1.089358e-04 -6.000000e+00 3.839641e-04 276.60 -2.00 20.00 -2.00 317.60 0.00e+00 2.175 0.000 302.00 328.00 3 3.7052e+00 2.8509e-03 3.0078e-02 -6.0000e+00 2.4403e-02 2.9793e-02 3.1816e-03 2.0390e-02 -6.0000e+00 2.6455e-02 -4.1872e-03 2.0586e-03 1.0077e-02 -6.0000e+00 1.5508e-02 -1.1038e-03 1.0531e-03 2.8556e-03 -6.0000e+00 6.3821e-03 9.3002e-04 -4.5265e-04 6.2473e-05 3.4742e-05 -6.0000e+00 4.8176e-04 4.1689e-04 1.6701e-05 12 1 1 12 1 1 99.47 22.37 0.21 0.00042 -0.00298 16 14 1 5 0 683.470 25.39 20.00 22.37 18.84 24.4 1003.81 -4938 -8669 -5535 -4484 -6717 -3490 -4990 278 -3837 -2795 -2772 1122 -4786 1019 -3074 -369 1338 -467 -422 -409 854 293 1428 -1651 712 416 -170 375 -354 949 710 866 -629 -1081 -1666 -949 -668 -51 145 -1330 -193 -750 -496 -810 -23 -707 -34 -114 -560 941 416 955 540 807 768 750 803 301 769 207 1227 978 1429 488 73 283 712 119 601 247 -35 182 -434 22 -636 371 66 216 471 -359 -581 -1310 -1382 -1281 -902 -1028 -481 -398 -223 116 495 237 823 1313 588 545 622 314 -309 -425 0 -537 285 -240 -732 -529 -420 -316 -30 -7 172 23 -117 -148 101 435 234 275 -20 -422 -588 -229 -30 16 239 213 1009 847 663 450 476 569 275 353 -63 -110 -39 103 -464 -102 -333 -475 -374 -309 -594 -379 -306 -432 -211 -324 19 -307 -235 -240 99 -484 114 -415 -54 208 -78 -74 -75 158 55 272 -328 147 90 -37 78 -74 196 158 202 -163 -291 -439 -246 -187 -16 54 -558 -89 -354 -242 -402 -11 -352 -16 -55 -285 481 217 535 313 494 490 493 538 203 508 136 822 676 1071 381 59 216 529 87 467 207 -32 164 -396 20 -542 294 50 155 352 -292 -516 -1261 -1393 -1367 -989 -1168 -574 -477 -268 138 569 259 831 1325 605 599 742 404 -416 -579 0 -661 337 -286 -901 -691 -559 -429 -43 -11 265 35 -184 -221 148 613 324 381 -29 -641 -896 -346 -45 23 340 296 1371 1144 920 657 722 875 437 566 -105 -192 -69 185 -845 -182 -588 -803 -629 SS 20210519T064320.9Z 7809.280103 233 1 52.00 2 62.01 93.89 106.80 20.20 0.00 1 0.00 1 0 25 9.513e-03 4.276e-03 2.460e-03 3.741e-04 3.455153e-01 1.972322e-04 4.553841e-03 -6.000000e+00 5.740524e-03 231.40 -2.00 3.88 -2.00 318.62 0.00e+00 4.075506e-04 3.652268e-05 1.272954e-04 -6.000000e+00 2.279038e-04 276.60 -2.00 20.00 -2.00 318.30 0.00e+00 2.120 0.000 302.00 328.00 3 1.4282e+00 5.3383e-04 2.9434e-02 -6.0000e+00 1.4484e-02 4.3407e-03 5.9880e-04 2.0060e-02 -6.0000e+00 1.5702e-02 -1.9893e-03 4.1875e-04 9.9871e-03 -6.0000e+00 9.2047e-03 -3.4583e-03 2.1990e-04 2.8689e-03 -6.0000e+00 3.7878e-03 9.8076e-03 -4.1928e-04 1.1853e-05 3.5424e-05 -6.0000e+00 2.8595e-04 8.3550e-04 1.7702e-05 10 0 0 10 0 0 99.66 22.37 0.20 0.00084 -0.00232 1405 276 1 5 0 35.225 25.39 20.00 22.37 19.20 24.5 1006.94 -2527 -3579 -2721 -2957 -2626 -3435 -1784 -1352 -1614 -1596 -1969 -291 -2144 -291 -453 -548 -751 -91 -172 -326 -49 335 479 -294 -449 -982 -814 -1008 -124 -455 -61 87 -89 -1319 -1629 -1229 -1657 -985 -957 -1157 -1161 -921 -825 -765 -264 -585 -327 -680 -112 482 692 835 1084 970 961 1129 820 651 667 1024 1233 1352 1464 864 477 347 256 411 678 438 78 -13 -5 -115 -81 100 -180 0 -168 -551 -776 -1097 -1361 -1084 -910 -736 -269 -144 34 -40 217 2 249 404 505 582 786 463 -199 -304 -368 -467 24 -123 -750 -589 -507 -267 156 265 240 195 185 106 193 336 251 149 -63 -408 -576 -140 -196 12 289 263 742 833 599 392 248 8 36 146 -179 -134 68 49 -204 -42 -192 -233 -202 -115 -170 -142 -148 -121 -155 -84 -71 -94 -99 -125 -19 -153 -24 -43 -58 -86 -11 -22 -43 -7 45 66 -43 -71 -162 -134 -159 -19 -68 -10 15 -17 -267 -321 -239 -350 -241 -280 -395 -440 -370 -342 -322 -111 -247 -137 -283 -46 201 306 397 550 487 503 607 451 359 362 551 680 797 938 596 336 234 163 257 448 324 63 -11 -4 -96 -63 70 -116 0 -108 -396 -633 -998 -1258 -1059 -945 -815 -313 -173 41 -47 238 2 248 390 510 607 915 599 -262 -403 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